ChemSpider 2D Image | 3-(2,5-Dimethylphenyl)-1-{[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2,4(1H,3H)-quinazolinedione | C25H19FN4O3

3-(2,5-Dimethylphenyl)-1-{[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2,4(1H,3H)-quinazolinedione

  • Molecular FormulaC25H19FN4O3
  • Average mass442.442 Da
  • Monoisotopic mass442.144104 Da
  • ChemSpider ID26310088

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2,4(1H,3H)-Quinazolinedione, 3-(2,5-dimethylphenyl)-1-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]- [ACD/Index Name]
3-(2,5-Dimethylphenyl)-1-{[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2,4(1H,3H)-quinazolinedione [ACD/IUPAC Name]
3-(2,5-Diméthylphényl)-1-{[3-(4-fluorophényl)-1,2,4-oxadiazol-5-yl]méthyl}-2,4(1H,3H)-quinazolinedione [French] [ACD/IUPAC Name]
3-(2,5-Dimethylphenyl)-1-{[3-(4-fluorphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2,4(1H,3H)-chinazolindion [German] [ACD/IUPAC Name]
1206989-84-5 [RN]
3-(2,5-dimethylphenyl)-1-((3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl)methyl)quinazoline-2,4(1H,3H)-dione
3-(2,5-dimethylphenyl)-1-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]quinazoline-2,4-dione
3-(2,5-dimethylphenyl)-1-{[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,2,3,4-tetrahydroquinazoline-2,4-dione
3-(2,5-dimethylphenyl)-1-{[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}quinazoline-2,4(1H,3H)-dione

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 628.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.0±3.0 kJ/mol
Flash Point: 333.9±34.3 °C
Index of Refraction: 1.643
Molar Refractivity: 117.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.20
ACD/LogD (pH 5.5): 4.52
ACD/BCF (pH 5.5): 1598.25
ACD/KOC (pH 5.5): 6835.44
ACD/LogD (pH 7.4): 4.52
ACD/BCF (pH 7.4): 1598.26
ACD/KOC (pH 7.4): 6835.47
Polar Surface Area: 80 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 60.1±3.0 dyne/cm
Molar Volume: 325.2±3.0 cm3

Click to predict properties on the Chemicalize site


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